methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-[phenyl(prop-2-enyl)amino]ethyl]sulfanyl-1H-pyrimidin-6-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-[phenyl(prop-2-enyl)amino]ethyl]sulfanyl-1H-pyrimidin-6-yl]ethanoate Openeye Name: methyl 2-[2-[2-(N-allylanilino)-2-oxo-ethyl]sulfanyl-4-oxo-1H-pyrimidin-6-yl]acetate CAS Name: 2-[4-oxo-2-[[2-oxo-2-(N-prop-2-enylanilino)ethyl]thio]-1H-pyrimidin-6-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-[2-oxo-2-(N-prop-2-enylanilino)ethyl]sulfanyl-1H-pyrimidin-6-yl]acetate Traditional Name: 2-[2-[[2-(N-allylanilino)-2-keto-ethyl]thio]-4-keto-1H-pyrimidin-6-yl]acetic acid methyl ester Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC(=O)N=C(N1)SCC(=O)N(CC=C)C2=CC=CC=C2

Isomeric SMILES

COC(=O)CC1=CC(=O)N=C(N1)SCC(=O)N(CC=C)C2=CC=CC=C2

InChI

InChI=1S/C18H19N3O4S/c1-3-9-21(14-7-5-4-6-8-14)16(23)12-26-18-19-13(10-15(22)20-18)11-17(24)25-2/h3-8,10H,1,9,11-12H2,2H3,(H,19,20,22)